C760-1054 Screening compound: N-[3-(4-benzylpiperidin-1-yl)propyl]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

C760-1054 Screening compound: N-[3-(4-benzylpiperidin-1-yl)propyl]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide
C760-1054 Screening compound: N-[3-(4-benzylpiperidin-1-yl)propyl]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C760-1054
N-[3-(4-benzylpiperidin-1-yl)propyl]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

C760-1054

Molecular Formula

C25H34N2OS (C25 H34 N2 OS)

Compound Name

N-[3-(4-benzylpiperidin-1-yl)propyl]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

IUPAC name

N-[3-(4-benzylpiperidin-1-yl)propyl]-4H5H6H7H8H-cyclohepta[b]thiophene-3-carboxamide

SMILES

O=C(c1csc2c1CCCCC2)NCCCN1CCC(Cc2ccccc2)CC1

InChI

InChI=1S/C25H34N2OS/c28-25(23-19-29-24-11-6-2-5-10-22(23)24)26-14-7-15-27-16-12-21(13-17-27)18-20-8-3-1-4-9-20/h1,3-4,8-9,19,21H,2,5-7,10-18H2,(H,26,28)

InChI Key

FUGQUMYCRBDYQM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14792059

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

410.62

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.823

Distribution Coefficient, logD

3.788

Water Solubility, LogSw

-5.78

Polar Surface Area

29.474

Acid Dissociation Constant (pKa)

14.85

Base Dissociation Constant (pKb)

9.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.00

C760-1054 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C760-1054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C760-1054?
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What is the minimum amount of C760-1054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C760-1054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C760-1054
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of C760-1054 available by request